4295-0602 Screening compound: (2Z)-2-[(3,4-dimethylphenyl)formamido]-N-[2-(2-methoxyphenyl)ethyl]-3-(thiophen-2-yl)prop-2-enamide

4295-0602 Screening compound: (2Z)-2-[(3,4-dimethylphenyl)formamido]-N-[2-(2-methoxyphenyl)ethyl]-3-(thiophen-2-yl)prop-2-enamide
4295-0602 Screening compound: (2Z)-2-[(3,4-dimethylphenyl)formamido]-N-[2-(2-methoxyphenyl)ethyl]-3-(thiophen-2-yl)prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4295-0602
(2Z)-2-[(3,4-dimethylphenyl)formamido]-N-[2-(2-methoxyphenyl)ethyl]-3-(thiophen-2-yl)prop-2-enamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

4295-0602

Molecular Formula

C25H26N2O3S (C25 H26 N2 O3 S)

Compound Name

(2Z)-2-[(3,4-dimethylphenyl)formamido]-N-[2-(2-methoxyphenyl)ethyl]-3-(thiophen-2-yl)prop-2-enamide

IUPAC name

(2Z)-2-[(34-dimethylphenyl)formamido]-N-[2-(2-methoxyphenyl)ethyl]-3-(thiophen-2-yl)prop-2-enamide

SMILES

Cc(cc1)c(C)cc1C(N/C(/C(NCCc(cccc1)c1OC)=O)=C\c1cccs1)=O

InChI

InChI=1S/C25H26N2O3S/c1-17-10-11-20(15-18(17)2)24(28)27-22(16-21-8-6-14-31-21)25(29)26-13-12-19-7-4-5-9-23(19)30-3/h4-11,14-16H,12-13H2,1-3H3,(H,26,29)(H,27,28)

InChI Key

UKZTYLDCULARLU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02319547

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.807

Distribution Coefficient, logD

4.160

Water Solubility, LogSw

-4.51

Polar Surface Area

55.067

Acid Dissociation Constant (pKa)

6.86

Base Dissociation Constant (pKb)

3.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

4295-0602 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4295-0602 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4295-0602?
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What is the minimum amount of 4295-0602 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4295-0602
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4295-0602
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 4295-0602 available by request